BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

400 related articles for article (PubMed ID: 22789527)

  • 1. Experimental and theoretical spectroscopic studies of anticancer drug rosmarinic acid using HF and density functional theory.
    Mariappan G; Sundaraganesan N; Manoharan S
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():340-51. PubMed ID: 22789527
    [TBL] [Abstract][Full Text] [Related]  

  • 2. The spectroscopic properties of anticancer drug Apigenin investigated by using DFT calculations, FT-IR, FT-Raman and NMR analysis.
    Mariappan G; Sundaraganesan N; Manoharan S
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Sep; 95():86-99. PubMed ID: 22617215
    [TBL] [Abstract][Full Text] [Related]  

  • 3. FT-IR, FT-Raman and UV spectral investigation: computed frequency estimation analysis and electronic structure calculations on chlorobenzene using HF and DFT.
    Govindarajan M; Karabacak M; Udayakumar V; Periandy S
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Mar; 88():37-48. PubMed ID: 22197345
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Vibrational spectroscopic studies of Isoleucine by quantum chemical calculations.
    Moorthi PP; Gunasekaran S; Ramkumaar GR
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Apr; 124():365-74. PubMed ID: 24508874
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Characterization of 1,5-dimethoxynaphthalene by vibrational spectroscopy (FT-IR and FT-Raman) and density functional theory calculations.
    Kandasamy M; Velraj G; Kalaichelvan S; Mariappan G
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jan; 134():191-9. PubMed ID: 25014641
    [TBL] [Abstract][Full Text] [Related]  

  • 6. The infrared, Raman, NMR and UV spectra, ab initio calculations and spectral assignments of 2-amino-4-chloro-6-methoxypyrimidine.
    Cinar Z; Karabacak M; Cinar M; Kurt M; Chinna Babu P; Sundaraganesan N
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Dec; 116():451-9. PubMed ID: 23973593
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Molecular structure and vibrational spectroscopic studies of Chrysin using HF and Density Functional Theory.
    Sundaraganesan N; Mariappan G; Manoharan S
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Feb; 87():67-76. PubMed ID: 22153594
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Molecular structure, vibrational spectroscopic (FT-IR, FT-Raman), UV and NBO analysis of 2-chlorobenzonitrile by density functional method.
    Krishnan AR; Saleem H; Subashchandrabose S; Sundaraganesan N; Sebastain S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Feb; 78(2):582-9. PubMed ID: 21190895
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Molecular structure investigation and spectroscopic studies on 2,3-difluorophenylboronic acid: a combined experimental and theoretical analysis.
    Karabacak M; Kose E; Atac A; Ali Cipiloglu M; Kurt M
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():892-908. PubMed ID: 22902933
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Spectroscopic (infrared, Raman, UV and NMR) analysis, Gaussian hybrid computational investigation (MEP maps/HOMO and LUMO) on cyclohexanone oxime.
    Ramalingam S; Karabacak M; Periandy S; Puviarasan N; Tanuja D
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():207-20. PubMed ID: 22683556
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Electronic absorption, vibrational spectra, nonlinear optical properties, NBO analysis and thermodynamic properties of N-(4-nitro-2-phenoxyphenyl) methanesulfonamide molecule by ab initio HF and density functional methods.
    Rajamani T; Muthu S; Karabacak M
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 May; 108():186-96. PubMed ID: 23474478
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Spectroscopic studies (FTIR, FT-Raman and UV), potential energy surface scan, normal coordinate analysis and NBO analysis of (2R,3R,4R,5S)-1-(2-hydroxyethyl)-2-(hydroxymethyl) piperidine-3,4,5-triol by DFT methods.
    Isac Paulraj E; Muthu S
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 May; 108():38-49. PubMed ID: 23454843
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Vibrational spectra, molecular structure, NBO, UV, NMR, first order hyperpolarizability, analysis of 4-Methoxy-4'-Nitrobiphenyl by density functional theory.
    Govindarasu K; Kavitha E
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Mar; 122():130-41. PubMed ID: 24299985
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Synthesis, structural, spectroscopic studies, NBO analysis, NLO and HOMO-LUMO of 4-methyl-N-(3-nitrophenyl)benzene sulfonamide with experimental and theoretical approaches.
    Sarojini K; Krishnan H; Kanakam CC; Muthu S
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 May; 108():159-70. PubMed ID: 23466326
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Quantum mechanical study of the structure and spectroscopic (FT-IR, FT-Raman, 13C, 1H and UV), first order hyperpolarizabilities, NBO and TD-DFT analysis of the 4-methyl-2-cyanobiphenyl.
    Sebastian S; Sundaraganesan N; Karthikeiyan B; Srinivasan V
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Feb; 78(2):590-600. PubMed ID: 21195659
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Quantum chemical studies on structure of 1-3-dibromo-5-chlorobenzene.
    Arivazhagan M; Meenakshi R
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Nov; 82(1):316-26. PubMed ID: 21835687
    [TBL] [Abstract][Full Text] [Related]  

  • 17. An experimental and theoretical investigation of Acenaphthene-5-boronic acid: conformational study, NBO and NLO analysis, molecular structure and FT-IR, FT-Raman, NMR and UV spectra.
    Karabacak M; Sinha L; Prasad O; Asiri AM; Cinar M
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Nov; 115():753-66. PubMed ID: 23892116
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Molecular structure, vibrational spectroscopic (FT-IR, FT-Raman), UV-vis spectra, first order hyperpolarizability, NBO analysis, HOMO and LUMO analysis, thermodynamic properties of benzophenone 2,4-dicarboxylic acid by ab initio HF and density functional method.
    Chaitanya K
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Feb; 86():159-73. PubMed ID: 22137747
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Spectroscopic (FT-IR/FT-Raman) and computational (HF/DFT) investigation and HOMO/LUMO/MEP analysis on 2-amino-4-chlorophenol.
    Ramalingam S; Periandy S; Karabacak M; Karthikeyan N
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Mar; 104():337-51. PubMed ID: 23274261
    [TBL] [Abstract][Full Text] [Related]  

  • 20. FT-IR and FT-Raman spectra, normal coordinate analysis and ab initio computations of Trimesic acid.
    Mahalakshmi G; Balachandran V
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Apr; 124():535-47. PubMed ID: 24508892
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 20.